Ligand name: (4S)-2-METHYL-2,4-PENTANEDIOL
PDB ligand accession: MPD
DrugBank: DB03564
PubChem: 5288834
ChEMBL: n/a
InChI Key: SVTBMSDMJJWYQN-YFKPBYRVSA-N
SMILES: CC(CC(C)(C)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Alcohols and polyols

List of PDB structures and/or AlphaFold models with target protein Q9WXQ8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3A1V	Download	Experimental	e3a1vA1 e3a1vA2 e3a1vB2	P-loop domains-like Cytosolic helical domain in ferrous iron transport protein B Cytosolic helical domain in ferrous iron transport protein B	LigPlot
3A1S	Download	Experimental	e3a1sA1 e3a1sA1 e3a1sB3	P-loop domains-like P-loop domains-like P-loop domains-like	LigPlot